Disodium 3-{[4-({4-[(2,4-Diamino-5-Nitrophenyl)Diazenyl]-5-Methoxy-2-Methylphenyl}Diazenyl)-1-Naphthyl]Diazenyl}-1,5-Naphthalenedisulfonate
[CAS# 6661-42-3]

Identification

• Name: Disodium 3-{[4-({4-[(2,4-Diamino-5-Nitrophenyl)Diazenyl]-5-Methoxy-2-Methylphenyl}Diazenyl)-1-Naphthyl]Diazenyl}-1,5-Naphthalenedisulfonate
• Synonyms: 1,5-Naphthalenedisulfonic acid, 3-[[4-[[4-[(2,4-diamino-5-nitrophenyl)azo]-5-methoxy-2-methylphenyl]azo]-1-naphthalenyl]azo]-, disodium salt
• Molecular Formula: C₃₄H₂₅N₉Na₂O₉S₂
• Molecular Weight: 813.73
• CAS Registry Number: 6661-42-3
• SMILES: Cc1cc(c(cc1N=Nc2ccc(c3c2cccc3)N=Nc4cc5c(cccc5S(=O)(=O)[O-])c(c4)S(=O)(=O)[O-])OC)N=Nc6cc(c(cc6N)N)[N+](=O)[O-].[Na+].[Na+]
• InChI: 1S/C34H27N9O9S2.2Na/c1-18-12-30(42-41-29-16-31(43(44)45)25(36)15-24(29)35)32(52-2)17-28(18)40-39-27-11-10-26(20-6-3-4-7-21(20)27)38-37-19-13-23-22(34(14-19)54(49,50)51)8-5-9-33(23)53(46,47)48;;/h3-17H,35-36H2,1-2H3,(H,46,47,48)(H,49,50,51);;/q;2*+1/p-2
• InChIKey: UPMWRIVRZYQKQF-UHFFFAOYSA-L